4-(3-nitrophenyl)sulfonyloxybutyl 3-nitrobenzenesulfonate

Systemtic Name: 4-(3-nitrophenyl)sulfonyloxybutyl 3-nitrobenzenesulfonate Openeye Name: 4-(3-nitrophenyl)sulfonyloxybutyl 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid 4-(3-nitrophenyl)sulfonyloxybutyl ester IUPAC Name: 4-(3-nitrophenyl)sulfonyloxybutyl 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid 4-(3-nitrophenyl)sulfonyloxybutyl ester Formula: C16H16N2O10S2 MolecularWeight: 460.43564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)OCCCCOS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)OCCCCOS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O10S2/c19-17(20)13-5-3-7-15(11-13)29(23,24)27-9-1-2-10-28-30(25,26)16-8-4-6-14(12-16)18(21)22/h3-8,11-12H,1-2,9-10H2